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DocumentationIdentifier: MM270164
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM270164 |
| SMILES |
C=C(C=C(C)F)N(C)C=N
|
| InChIKey |
MPUBNKVPKSCGIJ-UHFFFAOYSA-N
|
| MW [Da] |
142.18
Automatically obtained from RDkit software. |
| LogP |
1.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM136244
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| Tanimoto metric | 0.7388 |
|---|---|
| Cosine metric | 0.8595 |
| Dice metric | 0.8498 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM174427
Similarity: 0.7015
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| Tanimoto metric | 0.7015 |
|---|---|
| Cosine metric | 0.8376 |
| Dice metric | 0.8246 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 1.52 |
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| AI: | 0
Total active interactions
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MM174426
Similarity: 0.6866
Similarity to MM174426
| Tanimoto metric | 0.6866 |
|---|---|
| Cosine metric | 0.8286 |
| Dice metric | 0.8142 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+60 more
